2-[2-[4-[(5-chloranylthiophen-2-yl)methyl]piperazin-1-yl]carbonylphenyl]benzenecarbonitrile

Systemtic Name: 2-[2-[4-[(5-chloranylthiophen-2-yl)methyl]piperazin-1-yl]carbonylphenyl]benzenecarbonitrile Openeye Name: 2-[2-[4-[(5-chloro-2-thienyl)methyl]piperazine-1-carbonyl]phenyl]benzonitrile CAS Name: 2-[2-[[4-[(5-chloro-2-thiophenyl)methyl]-1-piperazinyl]-oxomethyl]phenyl]benzonitrile IUPAC Name: 2-[2-[4-[(5-chlorothiophen-2-yl)methyl]piperazine-1-carbonyl]phenyl]benzonitrile Traditional Name: 2-[2-[4-[(5-chloro-2-thienyl)methyl]piperazine-1-carbonyl]phenyl]benzonitrile Formula: C23H20ClN3OS MolecularWeight: 421.9424

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(S2)Cl)C(=O)C3=CC=CC=C3C4=CC=CC=C4C#N

Isomeric SMILES

C1CN(CCN1CC2=CC=C(S2)Cl)C(=O)C3=CC=CC=C3C4=CC=CC=C4C#N

InChI

InChI=1S/C23H20ClN3OS/c24-22-10-9-18(29-22)16-26-11-13-27(14-12-26)23(28)21-8-4-3-7-20(21)19-6-2-1-5-17(19)15-25/h1-10H,11-14,16H2